| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 21 | Yes |
Popular Name: (1S)-1-(4-isobutylphenyl)-N-(o-tolylmethyl)ethanamine (1S)-1-(4-isobutylphenyl)-N-(o-t…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 5.16 | 12.18 | -38.32 | 2 | 1 | 1 | 17 | 282.451 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.16 | 11.08 | -2.82 | 1 | 1 | 0 | 12 | 281.443 | 6 | ↓ |
